SMILES:
O=C(O)C(=O)O.O=C1c2ccccc2C(O)N1CCCN1CC=C(c2ccc(F)cc2)CC1Molecular Processing
Molecular formula
C24H25FN2O6
Molecular weight
456.47
Exact mass
456.1697
XLogP
2.61
TPSA
118.38
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
33
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.292
Molar refractivity
117.76
Supplementary Information
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